Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C23H16F3N3O3 |
| Molecular Weight | 439.3866 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OCC1=CC(OC2=CC3=CC=CC(C(=O)NC4=CC=CC(=C4)C(F)(F)F)=C3C=C2)=NC=N1
InChI
InChIKey=JNLSTLQFDDAULK-UHFFFAOYSA-N
InChI=1S/C23H16F3N3O3/c24-23(25,26)15-4-2-5-16(10-15)29-22(31)20-6-1-3-14-9-18(7-8-19(14)20)32-21-11-17(12-30)27-13-28-21/h1-11,13,30H,12H2,(H,29,31)
| Molecular Formula | C23H16F3N3O3 |
| Molecular Weight | 439.3866 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: CHEMBL279 Sources: https://www.ncbi.nlm.nih.gov/pubmed/26629594 |
2.7 nM [IC50] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 23:15:20 GMT 2025
by
admin
on
Mon Mar 31 23:15:20 GMT 2025
|
| Record UNII |
T1IV236CVP
|
| Record Status |
Validated (UNII)
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| Record Version |
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300000052072
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24756034
Created by
admin on Mon Mar 31 23:15:20 GMT 2025 , Edited by admin on Mon Mar 31 23:15:20 GMT 2025
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T1IV236CVP
Created by
admin on Mon Mar 31 23:15:20 GMT 2025 , Edited by admin on Mon Mar 31 23:15:20 GMT 2025
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890128-81-1
Created by
admin on Mon Mar 31 23:15:20 GMT 2025 , Edited by admin on Mon Mar 31 23:15:20 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
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TARGET -> INHIBITOR |
| Related Record | Type | Details | ||
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ACTIVE MOIETY |